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101-74-6 | Phenol, 4-[[4-(phenylamino)phenyl]amino]-
CAS No: 101-74-6 Catalog No: AG0003FY MDL No:
Product Description
Catalog Number:
AG0003FY
Chemical Name:
Phenol, 4-[[4-(phenylamino)phenyl]amino]-
CAS Number:
101-74-6
Molecular Formula:
C18H16N2O
Molecular Weight:
276.3324
IUPAC Name:
4-(4-anilinoanilino)phenol
InChI:
InChI=1S/C18H16N2O/c21-18-12-10-17(11-13-18)20-16-8-6-15(7-9-16)19-14-4-2-1-3-5-14/h1-13,19-21H
InChI Key:
JWKZWDVKRDSMLD-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Nc1ccc(cc1)Nc1ccccc1
EC Number:
202-971-8
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
276.339g/mol
Monoisotopic Mass:
276.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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